2-[(3,5-dimethyl-1-benzofuran-2-yl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(3,5-dimethyl-1-benzofuran-2-yl)carbonylamino]terephthalic acid Openeye Name: 2-[(3,5-dimethylbenzofuran-2-carbonyl)amino]terephthalic acid CAS Name: 2-[[(3,5-dimethyl-2-benzofuranyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(3,5-dimethyl-1-benzofuran-2-carbonyl)amino]terephthalic acid Traditional Name: 2-[(3,5-dimethylbenzofuran-2-carbonyl)amino]terephthalic acid Formula: C19H15NO6 MolecularWeight: 353.3255

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C19H15NO6/c1-9-3-6-15-13(7-9)10(2)16(26-15)17(21)20-14-8-11(18(22)23)4-5-12(14)19(24)25/h3-8H,1-2H3,(H,20,21)(H,22,23)(H,24,25)